3-(4-heptylphenyl)-3-oxidanyl-1-(2-pyridin-3-yl-1,3-thiazol-5-yl)propan-1-one

Systemtic Name: 3-(4-heptylphenyl)-3-oxidanyl-1-(2-pyridin-3-yl-1,3-thiazol-5-yl)propan-1-one Openeye Name: 3-(4-heptylphenyl)-3-hydroxy-1-[2-(3-pyridyl)thiazol-5-yl]propan-1-one CAS Name: 3-(4-heptylphenyl)-3-hydroxy-1-[2-(3-pyridinyl)-5-thiazolyl]-1-propanone IUPAC Name: 3-(4-heptylphenyl)-3-hydroxy-1-(2-pyridin-3-yl-1,3-thiazol-5-yl)propan-1-one Traditional Name: 3-(4-heptylphenyl)-3-hydroxy-1-[2-(3-pyridyl)thiazol-5-yl]propan-1-one Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(CC(=O)C2=CN=C(S2)C3=CN=CC=C3)O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(CC(=O)C2=CN=C(S2)C3=CN=CC=C3)O

InChI

InChI=1S/C24H28N2O2S/c1-2-3-4-5-6-8-18-10-12-19(13-11-18)21(27)15-22(28)23-17-26-24(29-23)20-9-7-14-25-16-20/h7,9-14,16-17,21,27H,2-6,8,15H2,1H3